3-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-methyl-amino]propanethioamide

Systemtic Name: 3-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-methyl-amino]propanethioamide Openeye Name: 3-[[2-(azepan-1-yl)-2-oxo-ethyl]-methyl-amino]propanethioamide CAS Name: 3-[[2-(1-azepanyl)-2-oxoethyl]-methylamino]propanethioamide IUPAC Name: 3-[[2-(azepan-1-yl)-2-oxoethyl]-methylamino]propanethioamide Traditional Name: 3-[[2-(azepan-1-yl)-2-keto-ethyl]-methyl-amino]thiopropionamide Formula: C12H23N3OS MolecularWeight: 257.39552

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)CC(=O)N1CCCCCC1

Isomeric SMILES

CN(CCC(=S)N)CC(=O)N1CCCCCC1

InChI

InChI=1S/C12H23N3OS/c1-14(9-6-11(13)17)10-12(16)15-7-4-2-3-5-8-15/h2-10H2,1H3,(H2,13,17)